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3 results in Authors: Pinwen Guan

Phase diagrams of alloys and their hydrides via on-lattice graph neural networks and limited training data

Matthew Witman, Norman Bartelt, Sanliang Ling, Pinwen Guan, Lauren Way, Mark Allendorf, Vitalie Stavila

Version 1 posted 21 November 2023

517

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Thermodynamic modeling of complex solid solutions in the Lu-H-N system via graph neural network accelerated Monte Carlo simulations

Pinwen Guan, Catalin Spataru, Vitalie Stavila, Reese Jones, Peter Sharma, Matthew Witman

Version 1 posted 19 August 2024

228

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LASSO for CALPHAD model selection enables data-efficient thermodynamic modeling: an application in thermochemical hydrogen production materials

Pinwen Guan, Bert Debusschere, Sean R. Bishop, Matthew Witman, Anthony H. McDaniel

Version 2 posted 06 May 2025

203

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